SCHEMBL20009373

SCHEMBL20009373

C/C(=C\C(Br)=C/NC=O)N1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
ALOX12 P18054 1/20 0.41
MAPT P10636 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21987011 0.66 ALDH1A1 (0.50) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL21987080 0.66 ALDH1A1 (0.50) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL22783869 0.65 ALDH1A1 (0.49) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL10583065 0.65 ALDH1A1 (0.49) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL10583061 0.65 ALDH1A1 (0.49) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL2673508 0.64 ALDH1A1 (0.47) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL456777 0.64 ALDH1A1 (0.47) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL2673510 0.64 ALDH1A1 (0.47) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL7127720 0.63 ALDH1A1 (0.44) USP2ALDH1A1LMNAALOX12MAPT
SCHEMBL7877240 0.63 ALDH1A1 (0.44) USP2ALDH1A1LMNAALOX12MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed